3-amino-N-methyl-2-propan-2-yloxybenzamide

C11H16N2O2 — CID 154814948

IUPAC3-amino-N-methyl-2-propan-2-yloxybenzamide
SMILESCNC(=O)c1cccc(N)c1OC(C)C
InChIInChI=1S/C11H16N2O2/c1-7(2)15-10-8(11(14)13-3)5-4-6-9(10)12/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNOIFWRKOKYDQFL-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.42
Rot. Bonds3

About 3-amino-N-methyl-2-propan-2-yloxybenzamide

3-amino-N-methyl-2-propan-2-yloxybenzamide (PubChem CID 154814948) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-amino-N-methyl-2-propan-2-yloxybenzamide.

Molecular Properties

Compound Name3-amino-N-methyl-2-propan-2-yloxybenzamide
PubChem CID154814948
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-amino-N-methyl-2-propan-2-yloxybenzamide
SMILESCNC(=O)c1cccc(N)c1OC(C)C
InChIInChI=1S/C11H16N2O2/c1-7(2)15-10-8(11(14)13-3)5-4-6-9(10)12/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNOIFWRKOKYDQFL-UHFFFAOYSA-N
XLogP1.42
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-methyl-2-(2-methylpropoxy)benzamide
CID 154814953
3-amino-2-ethoxy-N-methylbenzamide
CID 112693169
3-amino-2-bromo-N-methylbenzamide
CID 100681188
methyl 3-amino-2-(3-methylbutan-2-yloxy)benzoate
CID 112579913
3-amino-2-(1-carboxyethoxy)benzoic acid
CID 107077529
2-amino-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 43402957
3-fluoro-N-methyl-2-(1,1,1-trifluoropropan-2-yloxy)benzamide
CID 156722490
3-amino-N-[(2S)-2-hydroxypropyl]-2-methoxybenzamide
CID 107211143
3-amino-2-(4-methylpentan-2-yloxy)benzoic acid
CID 112579635
3-amino-2-methoxy-N-[(1S)-1-phenylethyl]benzamide
CID 107863919
3-amino-2-methoxy-N-[(1R)-1-phenylethyl]benzamide
CID 107863863
3-amino-2-(4-methoxybutan-2-yloxy)benzoic acid
CID 107077232

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-2-propan-2-yloxybenzamide?
The IUPAC name of 3-amino-N-methyl-2-propan-2-yloxybenzamide (CID 154814948) is 3-amino-N-methyl-2-propan-2-yloxybenzamide.
What is the SMILES notation for 3-amino-N-methyl-2-propan-2-yloxybenzamide?
The canonical SMILES for 3-amino-N-methyl-2-propan-2-yloxybenzamide is CNC(=O)c1cccc(N)c1OC(C)C.
What is the InChIKey of 3-amino-N-methyl-2-propan-2-yloxybenzamide?
The InChIKey is NOIFWRKOKYDQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(2)15-10-8(11(14)13-3)5-4-6-9(10)12/h4-7H,12H2,1-3H3,(H,13,14).
What are the key properties of 3-amino-N-methyl-2-propan-2-yloxybenzamide?
3-amino-N-methyl-2-propan-2-yloxybenzamide has a molecular weight of 208.26 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-2-propan-2-yloxybenzamide is sourced from PubChem (CID 154814948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).